SCHEMBL21027979

SCHEMBL21027979

COC(=O)C1CCc2cc3ccccc3n2C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.43
HTR2C P28335 4/20 0.43
NPC1 O15118 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
TSHR P16473 1/20 0.38
CREBBP Q92793 1/20 0.38
SIGMAR1 Q99720 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8328343 0.86 ALDH1A1 (0.45) HTR2AHTR2CHTTALDH1A1
SCHEMBL21028086 0.84 SMN1; SMN2 (0.39) HTR2AHTR2CALDH1A1
SCHEMBL21028295 0.84 SIGMAR1 (0.38) ALDH1A1SLC6A2SLC6A4SLC6A3SIGMAR1
SCHEMBL8447696 0.83 HTR2A (0.43) HTR2AHTR2CSIGMAR1
SCHEMBL8450784 0.83 HTR2A (0.39) HTR2AHTR2CSIGMAR1
SCHEMBL8450915 0.82 HTR2A (0.43) HTR2AHTR2CSIGMAR1
SCHEMBL13279281 0.77 HTR2A (0.40) HTR2AHTR2CTSHRSIGMAR1
SCHEMBL8658423 0.76 HTR2A (0.43) HTR2AHTR2CSIGMAR1
SCHEMBL8657721 0.75 ALDH1A1 (0.49) HTR2AHTR2CNPC1HTTRAB9A
SCHEMBL8446842 0.74 HTR2A (0.44) HTR2AHTR2CSIGMAR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11524958-B2 Tricyclic compound as CRTH2 inhibitor CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-12-13 US disclosed
US-20210403466-A1 TRICYCLIC COMPUND AS CRTH2 INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-12-30 US disclosed
EP-3489235-A1 TRICYCLIC COMPOUND AS CRTH2 INHIBITOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2019-05-29 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210403466-A1 TRICYCLIC COMPUND AS CRTH2 INHIBITOR NR3C2, CRHR2, CRHR1 HTR2A 604/4885HTR2C 749/4885NPC1 777/4885
US-11524958-B2 Tricyclic compound as CRTH2 inhibitor NR1H2, NR3C2, NR1H4 HTR2A 772/4885HTR2C 1011/4885NPC1 476/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.